2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine

C10H12FN3 — CID 83233296

IUPAC2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine
SMILESCc1cc(F)ccc1N1CCC(N)=N1
InChIInChI=1S/C10H12FN3/c1-7-6-8(11)2-3-9(7)14-5-4-10(12)13-14/h2-3,6H,4-5H2,1H3,(H2,12,13)
InChIKeyUAMDNTZEZHCVLV-UHFFFAOYSA-N
MW193.22 g/mol
LogP1.62
Rot. Bonds1

About 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine

2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine (PubChem CID 83233296) has the molecular formula C10H12FN3 and a molecular weight of 193.22 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine
PubChem CID83233296
Molecular FormulaC10H12FN3
Molecular Weight193.22 g/mol
Exact Mass193.10
IUPAC Name2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine
SMILESCc1cc(F)ccc1N1CCC(N)=N1
InChIInChI=1S/C10H12FN3/c1-7-6-8(11)2-3-9(7)14-5-4-10(12)13-14/h2-3,6H,4-5H2,1H3,(H2,12,13)
InChIKeyUAMDNTZEZHCVLV-UHFFFAOYSA-N
XLogP1.62
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethylphenyl)-3,4-dihydropyrazol-5-amine
CID 83240723
2-(4-fluoro-2-methylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole
CID 150560380
2-(4-fluoro-2-methylphenyl)triazole
CID 69088112
1-(4-fluoro-2-methylphenyl)piperidine;methanol
CID 159526986
(3S)-3-amino-1-(4-fluoro-2-methylphenyl)piperidin-2-one
CID 95240490
(4-fluoro-2-methylphenyl)-dimethylborane
CID 59420238
1-(4-fluoro-2-methylphenyl)-3-(furan-2-yl)pyrazol-5-amine
CID 63860689
5-amino-1-(4-fluoro-2-methylphenyl)-3-methylpyrazole-4-carboxylic acid
CID 153408760
1-(4-fluoro-2-methylphenyl)-5-(trifluoromethyl)pyrazol-3-amine
CID 79872711
4-amino-1-(4-fluoro-2-methylphenyl)pyrrolidin-2-one
CID 43521142
1-(4-fluoro-2-methylphenyl)piperidin-3-amine
CID 54594111
4-(6-fluoro-2,3-dihydroindol-1-yl)-3-methylbenzaldehyde
CID 103497669

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine (CID 83233296) is 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine is Cc1cc(F)ccc1N1CCC(N)=N1.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine?
The InChIKey is UAMDNTZEZHCVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3/c1-7-6-8(11)2-3-9(7)14-5-4-10(12)13-14/h2-3,6H,4-5H2,1H3,(H2,12,13).
What are the key properties of 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine?
2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine has a molecular weight of 193.22 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-3,4-dihydropyrazol-5-amine is sourced from PubChem (CID 83233296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).